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4H-1-Benzopyran-4-one, 2-(acetyloxy)-2,3-dihydro-7-methoxy-3-(3-methoxyphenoxy)-3-(4-methoxyphenyl)-, trans-(.+-.)-
SpectraBase Compound ID C7n8FBDiUpP
InChI InChI=1S/C26H24O8/c1-16(27)32-25-26(17-8-10-18(29-2)11-9-17,34-21-7-5-6-19(14-21)30-3)24(28)22-13-12-20(31-4)15-23(22)33-25/h5-15,25H,1-4H3/t25-,26+/m1/s1
InChIKey MMRCYOWCFZATRF-FTJBHMTQSA-N
Mol Weight 464.47 g/mol
Molecular Formula C26H24O8
Exact Mass 464.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzxfrIF6bOW
Name 4H-1-Benzopyran-4-one, 2-(acetyloxy)-2,3-dihydro-7-methoxy-3-(3-methoxyphenoxy)-3-(4-methoxyphenyl)-, trans-(.+-.)-
CAS Registry Number 113434-99-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24O8
InChI InChI=1S/C26H24O8/c1-16(27)32-25-26(17-8-10-18(29-2)11-9-17,34-21-7-5-6-19(14-21)30-3)24(28)22-13-12-20(31-4)15-23(22)33-25/h5-15,25H,1-4H3/t25-,26+/m1/s1
InChIKey MMRCYOWCFZATRF-FTJBHMTQSA-N
Molecular Weight 464.470 g/mol
SMILES [C@]1(C(c2ccc(cc2O[C@]1(OC(=O)C)[H])OC)=O)(Oc1cc(OC)ccc1)c1ccc(cc1)OC
SPLASH splash10-000j-0952000000-a66001fedd7a61d91448
Source of Spectrum KC-1987-1086-39
Synonyms (2S,3R)-7-methoxy-3-(3-methoxyphenoxy)-3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-2-yl acetate 2-Acetoxy-4',7-dimethoxy-3-(3''-methoxyphenyloxy)isoflavanone 2-Acetoxy-4',7-dimethoxy-3-(3''-methoxyphenyloxy)isoflavanone
Wiley ID 1391493